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3-pyridinecarboxylic acid, 4-(2-chlorophenyl)-6-[[2-[(4-chlorophenyl)amino]-2-oxoethyl]thio]-5-cyano-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
SpectraBase Compound ID KA4UnoEvS6E
InChI InChI=1S/C23H19Cl2N3O4S/c1-2-32-23(31)20-19(15-5-3-4-6-17(15)25)16(11-26)22(28-21(20)30)33-12-18(29)27-14-9-7-13(24)8-10-14/h3-10,19-20H,2,12H2,1H3,(H,27,29)(H,28,30)
InChIKey CIRUYKPCYDVCSP-UHFFFAOYSA-N
Mol Weight 504.39 g/mol
Molecular Formula C23H19Cl2N3O4S
Exact Mass 503.047333 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FPqR0ey0Y1h
Name 3-pyridinecarboxylic acid, 4-(2-chlorophenyl)-6-[[2-[(4-chlorophenyl)amino]-2-oxoethyl]thio]-5-cyano-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H19Cl2N3O4S/c1-2-32-23(31)20-19(15-5-3-4-6-17(15)25)16(11-26)22(28-21(20)30)33-12-18(29)27-14-9-7-13(24)8-10-14/h3-10,19-20H,2,12H2,1H3,(H,27,29)(H,28,30)
InChIKey CIRUYKPCYDVCSP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2274
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11238579